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Details

Stereochemistry RACEMIC
Molecular Formula C11H13N3OS
Molecular Weight 235.305
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZISOTHIAZOLE SULPHOXIDE

SMILES

[O-][S+]1N=C(N2CCNCC2)C3=C1C=CC=C3

InChI

InChIKey=MOBIZCKXBZKGFC-UHFFFAOYSA-N
InChI=1S/C11H13N3OS/c15-16-10-4-2-1-3-9(10)11(13-16)14-7-5-12-6-8-14/h1-4,12H,5-8H2

HIDE SMILES / InChI

Molecular Formula C11H13N3OS
Molecular Weight 235.305
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:49:22 GMT 2023
Edited
by admin
on Sat Dec 16 08:49:22 GMT 2023
Record UNII
S2229N6UPJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZISOTHIAZOLE SULPHOXIDE
Common Name English
ZIPRASIDONE (M2)
Common Name English
BMY-40729
Code English
BITP-SO
Common Name English
1,2-BENZISOTHIAZOLE, 3-(1-PIPERAZINYL)-, 1-OXIDE
Systematic Name English
BENZISOTHIAZOLE (BITP) SULPHOXIDE
Common Name English
ID-15002
Code English
Code System Code Type Description
FDA UNII
S2229N6UPJ
Created by admin on Sat Dec 16 08:49:22 GMT 2023 , Edited by admin on Sat Dec 16 08:49:22 GMT 2023
PRIMARY
CAS
128396-56-5
Created by admin on Sat Dec 16 08:49:22 GMT 2023 , Edited by admin on Sat Dec 16 08:49:22 GMT 2023
PRIMARY
PUBCHEM
15698633
Created by admin on Sat Dec 16 08:49:22 GMT 2023 , Edited by admin on Sat Dec 16 08:49:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID50577010
Created by admin on Sat Dec 16 08:49:22 GMT 2023 , Edited by admin on Sat Dec 16 08:49:22 GMT 2023
PRIMARY
Related Record Type Details
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